Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "af9286445958498e419736e25114cffa",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 57.341,
"b": 58.997,
"c": 210.306,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97857],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.18,1.84],
"number_observations_unique": 62904,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(meas)",
"value": 0.106
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 11.8
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 8.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [45.14,9.01],
"number_observations_unique": 3696,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.88,1.84],
"number_observations_unique": 3696,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.034
},
{
"type": "R(meas)",
"value": 1.185
},
{
"type": "R(pim)",
"value": 0.572
},
{
"type": "Redundancy",
"value": 7.8
},
{
"type": "CC(1/2)",
"value": 0.792
}
]
}
]
}